Diethyl P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]phosphonate

CAS Registry Number®

116384-53-3
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CAS Name

Diethyl P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]phosphonate

Molecular Formula

C12H20N5O4P

Molecular Mass

329.29

Cite this Page

Diethyl P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]phosphonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=116384-53-3 (retrieved 2024-06-26) (CAS RN: 116384-53-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    137 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H20N5O4P/c1-3-20-22(18,21-4-2)9-19-6-5-17-8-16-10-11(13)14-7-15-12(10)17/h7-8H,3-6,9H2,1-2H3,(H2,13,14,15)

InChIKey

InChIKey=SACBMARVYGBCAK-UHFFFAOYSA-N

SMILES

C(COCP(OCC)(OCC)=O)N1C=2C(N=C1)=C(N)N=CN2

Canonical SMILES

O=P(OCC)(OCC)COCCN1C=NC=2C(=NC=NC21)N

Other Names for this Substance

  • Phosphonic acid, P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-, diethyl ester
  • Phosphonic acid, [[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]-, diethyl ester
  • Diethyl P-[[2-(6-amino-9H-purin-9-yl)ethoxy]methyl]phosphonate
  • [[2-(6-Amino-9H-purin-9-yl)ethoxy]methyl]phosphonic acid diethyl ester

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